Chemical ID: 6322580

CC(C)C(=O)Nc1cc(c(cc1Cl)Cl)Cl
Chemical ID:
6322580
Name [?]:
2-methyl-N-(2,4,5-trichlorophenyl)-propanamide
SMILES [?]:
CC(C)C(=O)Nc1cc(c(cc1Cl)Cl)Cl
InChi [?]:
InChI=1/C10H10Cl3NO/c1-5(2)10(15)14-9-4-7(12)6(11)3-8(9)13/h3-5H,1-2H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,3,11,8,2,10,9,12,7,4,14,15,13,6,5/E:(1,2)/rA:15nCCCCONCCCCCCClClCl/rB:s1;s2;s2;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s10;s9;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10Cl3NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:9.22271
Area:428.102
Solvation:-1.47985
Coulombic:-21.7329
Bond Count [?]
All:15
Single:11
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:266.551
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.69
LogP (Chemaxon):3.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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